1TT8
CHORISMATE LYASE WITH PRODUCT, 1.0 A RESOLUTION
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 17-ID |
Synchrotron site | APS |
Beamline | 17-ID |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2000-05-18 |
Detector | MARRESEARCH |
Wavelength(s) | 0.7469 |
Spacegroup name | P 1 |
Unit cell lengths | 31.315, 33.849, 39.776 |
Unit cell angles | 67.57, 87.83, 65.66 |
Refinement procedure
Resolution | 8.000 - 1.000 |
R-factor | 0.1231 |
Rwork | 0.123 |
R-free | 0.15340 |
Structure solution method | SAD |
Starting model (for MR) | 1fw9 |
RMSD bond length | 0.017 |
RMSD bond angle | 0.035 |
Data reduction software | X-GEN |
Data scaling software | X-GEN |
Phasing software | SHELX |
Refinement software | SHELXL-97 |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 20.000 | 0.940 |
High resolution limit [Å] | 0.920 | 0.920 |
Rmerge | 0.066 | 0.262 |
Number of reflections | 88226 | |
<I/σ(I)> | 25.8 | |
Completeness [%] | 0.9 | 0.86 |
Redundancy | 4.6 | 1.7 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7 | 297 | 26% PEG4K, 80 mM Hepes, 5%(V/V) ISOPROPANOL, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 297K |